Compound Identification
SMILES
ClC1=CC=C(N\C=C2\C(=O)NN=C2C2=CC3=C(OCO3)C=C2)C=C1
InChIKey
InChIKey=YMTAEGLWBLCHGT-MDWZMJQESA-N
Formula
C17H12ClN3O3
Mass
341.75
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzodioxoles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzodioxoles
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzodioxoles
Alternative Parents
Aniline and substituted anilines Chlorobenzenes Pyrazolones Aryl chlorides Vinylogous amides Amino acids and derivatives Acetals Allylamines Secondary amines Oxacyclic compounds Azacyclic compounds Enamines Carbonyl compounds Organochlorides Organopnictogen compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzodioxole - Aniline or substituted anilines - Halobenzene - Chlorobenzene - Aryl chloride - Monocyclic benzene moiety - Pyrazolinone - Benzenoid - Aryl halide - Vinylogous amide - Pyrazoline - Amino acid or derivatives - Carboxylic acid derivative - Secondary amine - Acetal - Azacycle - Oxacycle - Enamine - Allylamine - Organic oxygen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Carbonyl group - Organic nitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Amine - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzodioxoles. These are organic compounds containing a benzene ring fused to either isomers of dioxole. Dioxole is a five-membered unsaturated ring of two oxygen atoms and three carbon atoms.
External Descriptors
Not available